5-(3-Nitrophenyl)-2-thiophenecarbaldehyde - CAS 38401-73-9
Catalog: |
BB023660 |
Product Name: |
5-(3-Nitrophenyl)-2-thiophenecarbaldehyde |
CAS: |
38401-73-9 |
Synonyms: |
5-(3-nitrophenyl)-2-thiophenecarboxaldehyde; 5-(3-nitrophenyl)thiophene-2-carbaldehyde |
IUPAC Name: | 5-(3-nitrophenyl)thiophene-2-carbaldehyde |
Description: | 5-(3-Nitrophenyl)-2-thiophenecarbaldehyde (CAS# 38401-73-9) is a useful research chemical. |
Molecular Weight: | 233.24 |
Molecular Formula: | C11H7NO3S |
Canonical SMILES: | C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(S2)C=O |
InChI: | InChI=1S/C11H7NO3S/c13-7-10-4-5-11(16-10)8-2-1-3-9(6-8)12(14)15/h1-7H |
InChI Key: | FWBJYBHOUJJDEN-UHFFFAOYSA-N |
LogP: | 3.65900 |
Complexity: | 279 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 233.01466426 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 233.01466426 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 91.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.9 |
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